(1Z,3Z)-6-(2-aminohydrazinyl)-5-methylidenehepta-1,3,6-trien-1-amine

C8H14N4 — CID 89468106

IUPAC(1Z,3Z)-6-(2-aminohydrazinyl)-5-methylidenehepta-1,3,6-trien-1-amine
SMILESC=C(/C=C\C=C/N)C(=C)NNN
InChIInChI=1S/C8H14N4/c1-7(5-3-4-6-9)8(2)11-12-10/h3-6,11-12H,1-2,9-10H2/b5-3-,6-4-
InChIKeyOITMXVIGSMATSQ-GLIMQPGKSA-N
MW166.23 g/mol
LogP0.05
Rot. Bonds5

About (1Z,3Z)-6-(2-aminohydrazinyl)-5-methylidenehepta-1,3,6-trien-1-amine

(1Z,3Z)-6-(2-aminohydrazinyl)-5-methylidenehepta-1,3,6-trien-1-amine (PubChem CID 89468106) has the molecular formula C8H14N4 and a molecular weight of 166.23 g/mol. Its IUPAC name is (1Z,3Z)-6-(2-aminohydrazinyl)-5-methylidenehepta-1,3,6-trien-1-amine.

Molecular Properties

Compound Name(1Z,3Z)-6-(2-aminohydrazinyl)-5-methylidenehepta-1,3,6-trien-1-amine
PubChem CID89468106
Molecular FormulaC8H14N4
Molecular Weight166.23 g/mol
Exact Mass166.12
IUPAC Name(1Z,3Z)-6-(2-aminohydrazinyl)-5-methylidenehepta-1,3,6-trien-1-amine
SMILESC=C(/C=C\C=C/N)C(=C)NNN
InChIInChI=1S/C8H14N4/c1-7(5-3-4-6-9)8(2)11-12-10/h3-6,11-12H,1-2,9-10H2/b5-3-,6-4-
InChIKeyOITMXVIGSMATSQ-GLIMQPGKSA-N
XLogP0.05
TPSA76.10 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.23
LogP ≤ 50.05
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (1Z,3Z)-6-(2-aminohydrazinyl)-5-methylidenehepta-1,3,6-trien-1-amine?
The IUPAC name of (1Z,3Z)-6-(2-aminohydrazinyl)-5-methylidenehepta-1,3,6-trien-1-amine (CID 89468106) is (1Z,3Z)-6-(2-aminohydrazinyl)-5-methylidenehepta-1,3,6-trien-1-amine.
What is the SMILES notation for (1Z,3Z)-6-(2-aminohydrazinyl)-5-methylidenehepta-1,3,6-trien-1-amine?
The canonical SMILES for (1Z,3Z)-6-(2-aminohydrazinyl)-5-methylidenehepta-1,3,6-trien-1-amine is C=C(/C=C\C=C/N)C(=C)NNN.
What is the InChIKey of (1Z,3Z)-6-(2-aminohydrazinyl)-5-methylidenehepta-1,3,6-trien-1-amine?
The InChIKey is OITMXVIGSMATSQ-GLIMQPGKSA-N. The full InChI is InChI=1S/C8H14N4/c1-7(5-3-4-6-9)8(2)11-12-10/h3-6,11-12H,1-2,9-10H2/b5-3-,6-4-.
What are the key properties of (1Z,3Z)-6-(2-aminohydrazinyl)-5-methylidenehepta-1,3,6-trien-1-amine?
(1Z,3Z)-6-(2-aminohydrazinyl)-5-methylidenehepta-1,3,6-trien-1-amine has a molecular weight of 166.23 g/mol, XLogP of 0.05, 5 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1Z,3Z)-6-(2-aminohydrazinyl)-5-methylidenehepta-1,3,6-trien-1-amine is sourced from PubChem (CID 89468106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).